5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol

C10H17F3O — CID 102202372

IUPAC5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol
SMILESCC1CCC(CCC(F)(F)F)C(O)C1
InChIInChI=1S/C10H17F3O/c1-7-2-3-8(9(14)6-7)4-5-10(11,12)13/h7-9,14H,2-6H2,1H3
InChIKeyWLZQXVWRXLHTCT-UHFFFAOYSA-N
MW210.24 g/mol
LogP3.13
Rot. Bonds2

About 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol

5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol (PubChem CID 102202372) has the molecular formula C10H17F3O and a molecular weight of 210.24 g/mol. Its IUPAC name is 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol
PubChem CID102202372
Molecular FormulaC10H17F3O
Molecular Weight210.24 g/mol
Exact Mass210.12
IUPAC Name5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol
SMILESCC1CCC(CCC(F)(F)F)C(O)C1
InChIInChI=1S/C10H17F3O/c1-7-2-3-8(9(14)6-7)4-5-10(11,12)13/h7-9,14H,2-6H2,1H3
InChIKeyWLZQXVWRXLHTCT-UHFFFAOYSA-N
XLogP3.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S,2R,5S)-5-methyl-2-propylcyclohexan-1-ol
CID 11899231
1,4-dimethyl-2-(3,3,3-trifluoropropyl)cyclopentane
CID 163832162
4-methyl-2-(2,2,2-trifluoroethyl)cyclohexan-1-ol
CID 79423179
(1R,2R,5S)-2,5-dimethylcyclohexan-1-ol
CID 12794034
(1R)-4-methylcyclohexane-1,2-diol
CID 89138285
(2R)-2-amino-4-methylcyclohexan-1-ol
CID 142197995
(1R,2S,5R)-2-fluoro-5-methylcyclohexan-1-ol
CID 126641319
2-fluoro-5-methylcyclohexan-1-ol
CID 89088193
2,5-dimethylcyclohexan-1-ol;propane
CID 142087287
5-methyl-2-(2-methylpentan-2-yl)cyclohexan-1-ol
CID 64766519
potassium 2,5-dimethylcyclohexan-1-ol
CID 18764424
lithium 2,5-dimethylcyclohexan-1-ol
CID 18764144

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol?
The IUPAC name of 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol (CID 102202372) is 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol.
What is the SMILES notation for 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol?
The canonical SMILES for 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol is CC1CCC(CCC(F)(F)F)C(O)C1.
What is the InChIKey of 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol?
The InChIKey is WLZQXVWRXLHTCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3O/c1-7-2-3-8(9(14)6-7)4-5-10(11,12)13/h7-9,14H,2-6H2,1H3.
What are the key properties of 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol?
5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol has a molecular weight of 210.24 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3,3,3-trifluoropropyl)cyclohexan-1-ol is sourced from PubChem (CID 102202372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).